3-chloro-N-[(4-cyanophenyl)methyl]-N-(5,6-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide

Chemical Structure Depiction of
3-chloro-N-[(4-cyanophenyl)methyl]-N-(5,6-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
Available: 237 mg
Amount:
mg
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Compound characteristics

Compound ID: D614-0169
Compound Name: 3-chloro-N-[(4-cyanophenyl)methyl]-N-(5,6-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
Molecular Weight: 432.87
Molecular Formula: C22 H17 Cl N6 O2
Smiles: [H]C([H])(c1ccc(C#N)cc1)N(C(c1cccc(c1)[Cl])=O)c1nc2NC(C)=C(C)C(n2n1)=O
Stereo: ACHIRAL
logP: 3.7082
logD: 3.3278
logSw: -4.2222
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 81.857
InChI Key: BUFBOFOQKYHODF-UHFFFAOYSA-N
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